3-[(2-tert-butylphenoxy)methyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[(2-tert-butylphenoxy)methyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(2-tert-butylphenoxy)methyl]-4-fluoro-benzonitrile CAS Name: 3-[(2-tert-butylphenoxy)methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(2-tert-butylphenoxy)methyl]-4-fluorobenzonitrile Traditional Name: 3-[(2-tert-butylphenoxy)methyl]-4-fluoro-benzonitrile Formula: C18H18FNO MolecularWeight: 283.340023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OCC2=C(C=CC(=C2)C#N)F

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OCC2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C18H18FNO/c1-18(2,3)15-6-4-5-7-17(15)21-12-14-10-13(11-20)8-9-16(14)19/h4-10H,12H2,1-3H3